N-[1-[3-(3-acetyl-7-methoxyindol-1-yl)propyl]piperidin-4-yl]-N-cyclopropylbenzenesulfonamide;1-[1-[3-(4-butylpiperidin-1-yl)propyl]indol-3-yl]ethanone;1-[1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[1-[3-[4-(2-chlorophenyl)piperazin-1-yl]propyl]-7-methoxyindol-3-yl]ethanone

C98H122Cl2N10O9S — CID 159944413

About N-[1-[3-(3-acetyl-7-methoxyindol-1-yl)propyl]piperidin-4-yl]-N-cyclopropylbenzenesulfonamide;1-[1-[3-(4-butylpiperidin-1-yl)propyl]indol-3-yl]ethanone;1-[1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[1-[3-[4-(2-chlorophenyl)piperazin-1-yl]propyl]-7-methoxyindol-3-yl]ethanone

N-[1-[3-(3-acetyl-7-methoxyindol-1-yl)propyl]piperidin-4-yl]-N-cyclopropylbenzenesulfonamide;1-[1-[3-(4-butylpiperidin-1-yl)propyl]indol-3-yl]ethanone;1-[1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[1-[3-[4-(2-chlorophenyl)piperazin-1-yl]propyl]-7-methoxyindol-3-yl]ethanone (PubChem CID 159944413) has the molecular formula C98H122Cl2N10O9S and a molecular weight of 1687.09 g/mol. Its IUPAC name is N-[1-[3-(3-acetyl-7-methoxyindol-1-yl)propyl]piperidin-4-yl]-N-cyclopropylbenzenesulfonamide;1-[1-[3-(4-butylpiperidin-1-yl)propyl]indol-3-yl]ethanone;1-[1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[1-[3-[4-(2-chlorophenyl)piperazin-1-yl]propyl]-7-methoxyindol-3-yl]ethanone.

Molecular Properties

• Compound Name: N-[1-[3-(3-acetyl-7-methoxyindol-1-yl)propyl]piperidin-4-yl]-N-cyclopropylbenzenesulfonamide;1-[1-[3-(4-butylpiperidin-1-yl)propyl]indol-3-yl]ethanone;1-[1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[1-[3-[4-(2-chlorophenyl)piperazin-1-yl]propyl]-7-methoxyindol-3-yl]ethanone
• PubChem CID: 159944413
• Molecular Formula: C98H122Cl2N10O9S
• Molecular Weight: 1687.09 g/mol
• Exact Mass: 1684.85
• IUPAC Name: N-[1-[3-(3-acetyl-7-methoxyindol-1-yl)propyl]piperidin-4-yl]-N-cyclopropylbenzenesulfonamide;1-[1-[3-(4-butylpiperidin-1-yl)propyl]indol-3-yl]ethanone;1-[1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[1-[3-[4-(2-chlorophenyl)piperazin-1-yl]propyl]-7-methoxyindol-3-yl]ethanone
• SMILES: CC(=O)c1cn(CCCN2CCC(Oc3ccccc3Cl)CC2)c2ccccc12.CCCCC1CCN(CCCn2cc(C(C)=O)c3ccccc32)CC1.COc1cccc2c(C(C)=O)cn(CCCN3CCC(N(C4CC4)S(=O)(=O)c4ccccc4)CC3)c12.COc1cccc2c(C(C)=O)cn(CCCN3CCN(c4ccccc4Cl)CC3)c12
• InChI: InChI=1S/C28H35N3O4S.C24H28ClN3O2.C24H27ClN2O2.C22H32N2O/c1-21(32)26-20-30(28-25(26)10-6-11-27(28)35-2)17-7-16-29-18-14-23(15-19-29)31(22-12-13-22)36(33,34)24-8-4-3-5-9-24;1-18(29)20-17-28(24-19(20)7-5-10-23(24)30-2)12-6-11-26-13-15-27(16-14-26)22-9-4-3-8-21(22)25;1-18(28)21-17-27(23-9-4-2-7-20(21)23)14-6-13-26-15-11-19(12-16-26)29-24-10-5-3-8-22(24)25;1-3-4-8-19-11-15-23(16-12-19)13-7-14-24-17-21(18(2)25)20-9-5-6-10-22(20)24/h3-6,8-11,20,22-23H,7,12-19H2,1-2H3;3-5,7-10,17H,6,11-16H2,1-2H3;2-5,7-10,17,19H,6,11-16H2,1H3;5-6,9-10,17,19H,3-4,7-8,11-16H2,1-2H3
• InChIKey: OBHOFADRQZDORO-UHFFFAOYSA-N
• XLogP: 19.85
• TPSA: 169.27 Ų
• H-Bond Acceptors: 18
• Rotatable Bonds: 32
• Heavy Atoms: 120
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1687.09
LogP ≤ 5	19.85
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	18

Frequently Asked Questions

What is the IUPAC name of N-[1-[3-(3-acetyl-7-methoxyindol-1-yl)propyl]piperidin-4-yl]-N-cyclopropylbenzenesulfonamide;1-[1-[3-(4-butylpiperidin-1-yl)propyl]indol-3-yl]ethanone;1-[1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[1-[3-[4-(2-chlorophenyl)piperazin-1-yl]propyl]-7-methoxyindol-3-yl]ethanone?

The IUPAC name of N-[1-[3-(3-acetyl-7-methoxyindol-1-yl)propyl]piperidin-4-yl]-N-cyclopropylbenzenesulfonamide;1-[1-[3-(4-butylpiperidin-1-yl)propyl]indol-3-yl]ethanone;1-[1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[1-[3-[4-(2-chlorophenyl)piperazin-1-yl]propyl]-7-methoxyindol-3-yl]ethanone (CID 159944413) is N-[1-[3-(3-acetyl-7-methoxyindol-1-yl)propyl]piperidin-4-yl]-N-cyclopropylbenzenesulfonamide;1-[1-[3-(4-butylpiperidin-1-yl)propyl]indol-3-yl]ethanone;1-[1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[1-[3-[4-(2-chlorophenyl)piperazin-1-yl]propyl]-7-methoxyindol-3-yl]ethanone.

What is the SMILES notation for N-[1-[3-(3-acetyl-7-methoxyindol-1-yl)propyl]piperidin-4-yl]-N-cyclopropylbenzenesulfonamide;1-[1-[3-(4-butylpiperidin-1-yl)propyl]indol-3-yl]ethanone;1-[1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[1-[3-[4-(2-chlorophenyl)piperazin-1-yl]propyl]-7-methoxyindol-3-yl]ethanone?

The canonical SMILES for N-[1-[3-(3-acetyl-7-methoxyindol-1-yl)propyl]piperidin-4-yl]-N-cyclopropylbenzenesulfonamide;1-[1-[3-(4-butylpiperidin-1-yl)propyl]indol-3-yl]ethanone;1-[1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[1-[3-[4-(2-chlorophenyl)piperazin-1-yl]propyl]-7-methoxyindol-3-yl]ethanone is CC(=O)c1cn(CCCN2CCC(Oc3ccccc3Cl)CC2)c2ccccc12.CCCCC1CCN(CCCn2cc(C(C)=O)c3ccccc32)CC1.COc1cccc2c(C(C)=O)cn(CCCN3CCC(N(C4CC4)S(=O)(=O)c4ccccc4)CC3)c12.COc1cccc2c(C(C)=O)cn(CCCN3CCN(c4ccccc4Cl)CC3)c12.

What is the InChIKey of N-[1-[3-(3-acetyl-7-methoxyindol-1-yl)propyl]piperidin-4-yl]-N-cyclopropylbenzenesulfonamide;1-[1-[3-(4-butylpiperidin-1-yl)propyl]indol-3-yl]ethanone;1-[1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[1-[3-[4-(2-chlorophenyl)piperazin-1-yl]propyl]-7-methoxyindol-3-yl]ethanone?

The InChIKey is OBHOFADRQZDORO-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H35N3O4S.C24H28ClN3O2.C24H27ClN2O2.C22H32N2O/c1-21(32)26-20-30(28-25(26)10-6-11-27(28)35-2)17-7-16-29-18-14-23(15-19-29)31(22-12-13-22)36(33,34)24-8-4-3-5-9-24;1-18(29)20-17-28(24-19(20)7-5-10-23(24)30-2)12-6-11-26-13-15-27(16-14-26)22-9-4-3-8-21(22)25;1-18(28)21-17-27(23-9-4-2-7-20(21)23)14-6-13-26-15-11-19(12-16-26)29-24-10-5-3-8-22(24)25;1-3-4-8-19-11-15-23(16-12-19)13-7-14-24-17-21(18(2)25)20-9-5-6-10-22(20)24/h3-6,8-11,20,22-23H,7,12-19H2,1-2H3;3-5,7-10,17H,6,11-16H2,1-2H3;2-5,7-10,17,19H,6,11-16H2,1H3;5-6,9-10,17,19H,3-4,7-8,11-16H2,1-2H3.

What are the key properties of N-[1-[3-(3-acetyl-7-methoxyindol-1-yl)propyl]piperidin-4-yl]-N-cyclopropylbenzenesulfonamide;1-[1-[3-(4-butylpiperidin-1-yl)propyl]indol-3-yl]ethanone;1-[1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[1-[3-[4-(2-chlorophenyl)piperazin-1-yl]propyl]-7-methoxyindol-3-yl]ethanone?

N-[1-[3-(3-acetyl-7-methoxyindol-1-yl)propyl]piperidin-4-yl]-N-cyclopropylbenzenesulfonamide;1-[1-[3-(4-butylpiperidin-1-yl)propyl]indol-3-yl]ethanone;1-[1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[1-[3-[4-(2-chlorophenyl)piperazin-1-yl]propyl]-7-methoxyindol-3-yl]ethanone has a molecular weight of 1687.09 g/mol, XLogP of 19.85, 32 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for N-[1-[3-(3-acetyl-7-methoxyindol-1-yl)propyl]piperidin-4-yl]-N-cyclopropylbenzenesulfonamide;1-[1-[3-(4-butylpiperidin-1-yl)propyl]indol-3-yl]ethanone;1-[1-[3-[4-(2-chlorophenoxy)piperidin-1-yl]propyl]indol-3-yl]ethanone;1-[1-[3-[4-(2-chlorophenyl)piperazin-1-yl]propyl]-7-methoxyindol-3-yl]ethanone is sourced from PubChem (CID 159944413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).